2-azanyl-N-(6-methylheptan-2-yl)-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(6-methylheptan-2-yl)-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-benzyl-N-(1,5-dimethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(6-methylheptan-2-yl)-1-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-benzyl-N-(6-methylheptan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-benzyl-N-(1,5-dimethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)N

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)N

InChI

InChI=1S/C26H31N5O/c1-17(2)10-9-11-18(3)28-26(32)22-23-25(30-21-15-8-7-14-20(21)29-23)31(24(22)27)16-19-12-5-4-6-13-19/h4-8,12-15,17-18H,9-11,16,27H2,1-3H3,(H,28,32)